Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.43 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.42 |
| ▸ | TBXAS1 | P24557 | 7/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | ANPEP | P15144 | 1/20 | 0.41 |
| ▸ | ERAP2 | Q6P179 | 1/20 | 0.41 |
| ▸ | ERAP1 | Q9NZ08 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.41 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL8479405 | 0.92 | NPC1 (0.44) | HTTKMT2ASMN1; SMN2NPC1RAB9A | |
| SCHEMBL8482634 | 0.92 | BACE1 (0.48) | HTTKMT2ASMN1; SMN2NPC1RAB9A | |
| SCHEMBL27527912 | 0.88 | L3MBTL1 (0.45) | KMT2ASMN1; SMN2NPC1RAB9AL3MBTL1 | |
| SCHEMBL8479651 | 0.85 | BACE1 (0.50) | NPC1RAB9AL3MBTL1CYP2D6CYP3A4 | |
| SCHEMBL12811173 | 0.85 | CYP1A2 (0.44) | KMT2ARAB9ACYP1A2CYP2D6CYP3A4 | |
| SCHEMBL8550527 | 0.83 | BACE1 (0.48) | NPC1RAB9AL3MBTL1CYP2D6CYP3A4 | |
| SCHEMBL5016747 | 0.81 | CHRNA7 (0.57) | L3MBTL1CYP1A2CYP2D6CHRNA7TBXAS1 | |
| SCHEMBL8479504 | 0.81 | CYP11B2 (0.44) | HTTSMN1; SMN2NPC1RAB9AL3MBTL1 | |
| SCHEMBL8479680 | 0.80 | CLK4 (0.41) | KMT2ANPC1RAB9AL3MBTL1 | |
| SCHEMBL8592667 | 0.80 | CLK4 (0.41) | KMT2ANPC1RAB9AL3MBTL1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1074544-B1 | Process for production of 3-(3-pyridyl)-1-propanol derivatives | KANEKA CORP (JP) | 2003-08-27 | — | — | EP | disclosed |
| US-6388086-B1 | REACTING W 3-METHYLPYRIDINE WITH BASE; THEN EPOXY COMPOUND | KANEKA CORPORATION (JP) | 2002-05-14 | — | — | US | disclosed |
| EP-1074544-A1 | Process for production of 3-(3-pyridyl)-1-propanol derivatives | KANEKA CORPORATION (JP) | 2001-02-07 | — | — | EP | disclosed |
| US-5977105-A | Compounds | ASTRA PHARMAEUTICALS LTD. (GB) | 1999-11-02 | — | — | US | disclosed |
| EP-0865431-A2 | COMPOUNDS | Astra Pharmaceuticals Limited (GB) | 1998-09-23 | — | — | EP | disclosed |
| WO-1997020815-A1 | COMPOUNDS | ASTRA PHARMACEUTICALS LTD. (GB) | 1997-06-12 | — | — | WO | disclosed |